Geometry & MOs

Info

ID:

181767

PubChem CID:

76790627

Reduced:

O3F6C38H40 (1)

Stoich.:

A3B6C38D40 (1)

Weight, g/mol:

1590.980106

ΔHf, kcal/mol:

-374.44

Dipole, Da:

4.61

IP(EA), eV:

 -9.2(-0.41)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

disodium;2-[[3-[2-[[3-(3-dodec-5-enoyloxydecoxy)-2-(3-oxotetradecanoylamino)propoxy]-oxidophosphoryl]oxyethylamino]-3-oxopropanoyl]amino]ethyl [3-(3-hept-5-enoyloxydecoxy)-2-(3-oxotetradecanoylamino)propyl] phosphate

Drug info:

PubChemData

Smile

CCOC1=C(C(=C(C=C1)C2=C(C(=C(C=C2)C3CCC(CC3)OC(=O)C4CCC(CC4)C5=C(C(=C(C=C5)CCC=CC)F)F)F)F)F)F

DOS

IR

Vibrations